Glycoside
GD037894
Name:
n-[(1r,2s,3r,4r,5r)-2-[(2s,3r,4r,5s,6r)-3-acetamido-6-(hydroxymethyl)-4,5-bis(oxidanyl)oxan-2-yl]oxy-3-oxidanyl-6,8-dioxabicyclo[3.2.1]octan-4-yl]ethanamideFormula:
C16H26O10N2Smiles:
CC(=O)N[C@@H]1[C@@H](O[C@H]2[C@@H]3CO[C@@H](O3)[C@H](NC(C)=O)[C@H]2O)O[C@H](CO)[C@H](O)[C@@H]1OAglycone:
CC(=O)NC1C2OCC(O2)C(O)C1OSugarmoiety:
CC(=O)NC1C(O)OC(CO)C(O)C1OOther Identifiers
Properties
| HBA: | 12 | RingCount: | 3 |
| HBD: | 6 | FractionCSP3: | 0.88 |
| AlogP: | -4.06 | Num_rotatable_bonds: | 5 |
| MolWt: | 406.39 | Num_heavy_atoms: | 28 |
| TPSA: | 176.04 | NumAromaticRings: | 0 |
Unique Aglycone
AD23768
Formula: C8H13O5N
Smiles:
CC(=O)NC1C2OCC(O2)C(O)C1O| HBA: | 6 | RingCount: | 2 |
| HBD: | 3 | FractionCSP3: | 0.88 |
| AlogP: | -2.03 | Num_rotatable_bonds: | 1 |
| MolWt: | 203.19 | Num_heavy_atoms: | 14 |
| TPSA: | 88.02 | NumAromaticRings: | 0 |
